(alphaS,3R,4R)-4-(3-Hydroxyphenyl)-3,4-dimethyl-alpha-(phenylmethyl)-1-piperidinepropanoic acid methyl ester

  • Name:(alphaS,3R,4R)-4-(3-Hydroxyphenyl)-3,4-dimethyl-alpha-(phenylmethyl)-1-piperidinepropanoic acid methyl ester
  • CAS:170098-29-0
  • Purity:99%
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Factory Export Top Purity (alphaS,3R,4R)-4-(3-Hydroxyphenyl)-3,4-dimethyl-alpha-(phenylmethyl)-1-piperidinepropanoic acid methyl ester 170098-29-0 In Stock

  • Molecular Formula:C24H31NO3
  • Molecular Weight:381.515
  • Boiling Point:520℃ 
  • PKA:9.96±0.10(Predicted) 
  • Flash Point:268℃ 
  • PSA：49.77000 
  • Density:1.089 
  • LogP:3.96150 

(alphaS,3R,4R)-4-(3-Hydroxyphenyl)-3,4-dimethyl-alpha-(phenylmethyl)-1-piperidinepropanoic acid methyl ester(Cas 170098-29-0) Usage

General Description

The chemical compound "(alphaS,3R,4R)-4-(3-Hjsonidsroxyphenyl)-3,4-dimethyl-alpha-(phenylmethyl)-1-piperidinepropanoic acid methyl ester" is a complex molecule with specific stereochemistry. It contains a piperidine ring, a phenylmethyl group, and a carboxylic acid methyl ester. The compound also includes a 3-hydroxyphenyl group and is a derivative of propanoic acid. (alphaS,3R,4R)-4-(3-Hydroxyphenyl)-3,4-dimethyl-alpha-(phenylmethyl)-1-piperidinepropanoic acid methyl ester may have potential pharmacological or biochemical applications due to its structural features. However, further research and testing would be needed to fully understand its properties and potential uses.

InChI:InChI=1S/C24H31NO3/c1-18-16-25(13-12-24(18,2)21-10-7-11-22(26)15-21)17-20(23(27)28-3)14-19-8-5-4-6-9-19/h4-11,15,18,20,26H,12-14,16-17H2,1-3H3/t18-,20-,24+/m0/s1

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170098-29-0 Process route

benzyl bromide
100-39-0

benzyl bromide

methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate
170098-39-2

methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate

methyl (αS,3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-α-(phenylmethyl)-1-piperidinepropanoate
170098-29-0

methyl (αS,3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-α-(phenylmethyl)-1-piperidinepropanoate

Conditions
Conditions Yield
methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate; With n-butyllithium; diisopropylamine; In tetrahydrofuran; hexane; n-heptane; at -25 - 30 ℃; for 2.5 - 5h;
benzyl bromide; In tetrahydrofuran; hexane; n-heptane; at -25 - -20 ℃; for 18h;
benzyl bromide
100-39-0

benzyl bromide

methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate
170098-39-2

methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate

methyl (αS,3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-α-(phenylmethyl)-1-piperidinepropanoate
170098-29-0

methyl (αS,3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-α-(phenylmethyl)-1-piperidinepropanoate

methyl (αS,3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-α-(phenylmethyl)-1-piperidinepropanoate

methyl (αS,3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-α-(phenylmethyl)-1-piperidinepropanoate

Conditions
Conditions Yield
benzyl bromide; methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate; With lithium diisopropyl amide; at -35 - -30 ℃;
With hydrogenchloride; In methanol; at 0 - 5 ℃; for 2h;
33%
With lithium diisopropyl amide; Yield given. Multistep reaction. Yields of byproduct given. Title compound not separated from byproducts; 1.) THF, -30 deg C, 15 min, 2.) -15 - -20 deg C, 3 h;

170098-29-0 Upstream products

  • 100-39-0
    100-39-0

    benzyl bromide

  • 170098-39-2
    170098-39-2

    methyl (3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinepropanoate

  • 119193-19-0
    119193-19-0

    3-[(3R,4R)-3,4-dimethylpiperidin-4-yl]phenol

  • 145678-86-0
    145678-86-0

    (3R,4R)-3,4-dimethyl-4-<3-(1-methylethoxy)phenyl>piperidinecarboxylic acid phenyl ester

170098-29-0 Downstream products

  • 762299-98-9
    762299-98-9

    (S)-methyl 2-benzyl-3-((3R,4R)-3,4-dimethyl-4-(3-(trifluoromethyl-sulfonyloxy)phenyl)piperidin-1-yl)propanoate

  • 156130-41-5
    156130-41-5

    ADL 08-0011

  • 145603-86-7
    145603-86-7

    (+)-<<2'(S)-<<4(R)-3-(hydroxyphenyl)-3(R),4-dimethyl-1-piperidinyl>methyl>-1-oxo-3-phenylpropyl>amino>acetic acid 2-methylpropyl ester

  • 156053-89-3
    156053-89-3

    Entereg

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